3-nitro-N-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylethyl]benzamide

Systemtic Name: 3-nitro-N-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylethyl]benzamide Openeye Name: 3-nitro-N-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylethyl]benzamide CAS Name: 3-nitro-N-[2-[[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]sulfonyl]ethyl]benzamide IUPAC Name: 3-nitro-N-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylethyl]benzamide Traditional Name: 3-nitro-N-[2-[4-[3-(trifluoromethyl)phenyl]piperazino]sulfonylethyl]benzamide Formula: C20H21F3N4O5S MolecularWeight: 486.46475

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)S(=O)(=O)CCNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)S(=O)(=O)CCNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21F3N4O5S/c21-20(22,23)16-4-2-5-17(14-16)25-8-10-26(11-9-25)33(31,32)12-7-24-19(28)15-3-1-6-18(13-15)27(29)30/h1-6,13-14H,7-12H2,(H,24,28)